4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide

C16H20N4O3S — CID 110712586

IUPAC4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NC2CCN(c3ncccn3)CC2)cc1
InChIInChI=1S/C16H20N4O3S/c1-23-14-3-5-15(6-4-14)24(21,22)19-13-7-11-20(12-8-13)16-17-9-2-10-18-16/h2-6,9-10,13,19H,7-8,11-12H2,1H3
InChIKeyVYAJWNWWGGDPPC-UHFFFAOYSA-N
MW348.43 g/mol
LogP1.43
Rot. Bonds5

About 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide

4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide (PubChem CID 110712586) has the molecular formula C16H20N4O3S and a molecular weight of 348.43 g/mol. Its IUPAC name is 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide
PubChem CID110712586
Molecular FormulaC16H20N4O3S
Molecular Weight348.43 g/mol
Exact Mass348.13
IUPAC Name4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NC2CCN(c3ncccn3)CC2)cc1
InChIInChI=1S/C16H20N4O3S/c1-23-14-3-5-15(6-4-14)24(21,22)19-13-7-11-20(12-8-13)16-17-9-2-10-18-16/h2-6,9-10,13,19H,7-8,11-12H2,1H3
InChIKeyVYAJWNWWGGDPPC-UHFFFAOYSA-N
XLogP1.43
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide
CID 23609654
4-methoxy-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzenesulfonamide
CID 90621518
3,4-dimethyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide
CID 110712587
3,4-difluoro-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide
CID 55906495
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-4-methoxybenzenesulfonamide
CID 5303878
2-methylsulfonyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide
CID 55905841
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-methoxybenzenesulfonamide
CID 50823745
N-cyclopropyl-4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzenesulfonamide
CID 30690904
4-methoxy-N-(1-propanoylpiperidin-4-yl)benzenesulfonamide
CID 110819170
N-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]benzenesulfonamide
CID 18137019
4-[(4-methoxyphenyl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 60808728
N-[1-(3-chloro-2-pyridinyl)piperidin-4-yl]-3,4-dimethoxybenzenesulfonamide
CID 171682723

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide (CID 110712586) is 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide is COc1ccc(S(=O)(=O)NC2CCN(c3ncccn3)CC2)cc1.
What is the InChIKey of 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide?
The InChIKey is VYAJWNWWGGDPPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3S/c1-23-14-3-5-15(6-4-14)24(21,22)19-13-7-11-20(12-8-13)16-17-9-2-10-18-16/h2-6,9-10,13,19H,7-8,11-12H2,1H3.
What are the key properties of 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide?
4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide has a molecular weight of 348.43 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzenesulfonamide is sourced from PubChem (CID 110712586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).